canSAR2060476
FEATURES
Loading...
NAMES
    SMILES
    CN1CCN(CCCOc2ccc(N3C(=O)/C(=C/c4ccc(Oc5ccc(Cl)cc5)cc4)SC3=S)cc2)CC1
    InChI
    InChI=1S/C30H30ClN3O3S2/c1-32-16-18-33(19-17-32)15-2-20-36-25-13-7-24(8-14-25)34-29(35)28(39-30(34)38)21-22-3-9-26(10-4-22)37-27-11-5-23(31)6-12-27/h3-14,21H,2,15-20H2,1H3/b28-21-
    MOLECULAR FORMULA
    C30H30ClN3O3S2
    CROSS REFERENCES
    Loading...
    canSAR2060476
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight579.14
    AlogP6.55
    HBond donors0
    HBond acceptors6
    Atoms69
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2060476.